CHEMBL310742
| SMILES | CC1(C)SSC(C)(C)[C@@H](NC(=O)[C@]2(N)CCC3C=C(O)C=CC3C2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H]1C(=O)O |
| InChIKey | IWDKQFKJJQRUSL-XKZJSZITSA-N |
Chemical properties
| Hydrogen bond acceptors | 9 |
| Hydrogen bond donors | 7 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 673.3 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| δ | OPRD | Mouse | Opioid | A | pIC50 | 6.86 | 7.26 | 7.66 | ChEMBL |
| μ | OPRM | Rat | Opioid | A | pIC50 | 5.55 | 5.7 | 5.84 | ChEMBL |
| δ | OPRD | Human | Opioid | A | pIC50 | 5.18 | 5.32 | 5.46 | ChEMBL |